SCHEMBL287568

SCHEMBL287568

[c]1cn(Cc2ccccc2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.48
CYP11B2 P19099 5/20 0.48
CYP19A1 P11511 4/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
TBXAS1 P24557 1/20 0.48
QPCT Q16769 1/20 0.48
CYP4Z1 Q86W10 1/20 0.48
QPCTL Q9NXS2 1/20 0.48
CYP17A1 P05093 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
HPGDS O60760 1/20 0.38
TNF P01375 1/20 0.38
F2 P00734 1/20 0.38
PLG P00747 1/20 0.38
ELANE P08246 1/20 0.38
CTSG P08311 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5982678 0.83 CYP11B1 (0.56) CYP11B1CYP11B2MAPTSIGMAR1CYP2C9
SCHEMBL5982789 0.82 CYP11B1 (0.50) CYP11B1CYP11B2CYP19A1POLBMAPT
SCHEMBL5981998 0.81 CYP11B1 (0.51) CYP11B1CYP11B2CYP19A1POLBMAPT
SCHEMBL5982570 0.81 CYP11B1 (0.51) CYP11B1CYP11B2CYP19A1POLBMAPT
SCHEMBL5982474 0.79 CYP11B1 (0.56) CYP11B1CYP11B2CYP3A4CYP1A2POLB
SCHEMBL5982288 0.78 SIGMAR1 (0.46) POLBSIGMAR1GSK3AGSK3B
SCHEMBL5983231 0.77 KDM4E (0.46) CYP11B1CYP11B2CYP19A1MAPTSIGMAR1
SCHEMBL5982487 0.76 LPO (0.52) MAPTSIGMAR1CMA1IDO1ALDH1A1
SCHEMBL1535118 0.72 CYP19A1 (0.57) CYP11B1CYP11B2CYP19A1CYP3A4CYP2D6
SCHEMBL5982010 0.71 CYP19A1 (0.54) CYP19A1CYP2D6SIGMAR1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 81 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108707115-A A kind of synthetic method of acrylic acid derivative 成都道合尔医药技术有限公司 2018-10-26 CN claimed
EP-0480918-A1 REDUCED SIZE LHRH ANALOGS ABBOTT LABORATORIES (US) 1992-04-22 EP claimed
EP-0480918-A4 REDUCED SIZE LHRH ANALOGS. ABBOTT LAB (US) 1991-06-04 EP claimed
EP-0400065-A4 LHRH ANALOGS 1991-03-13 EP claimed
EP-0400065-A1 LHRH ANALOGS. ABBOTT LAB (US) 1990-12-05 EP claimed
WO-1989007451-A1 REDUCED SIZE LHRH ANALOGS ABBOTT LABORATORIES (US) 1989-08-24 WO claimed
WO-1989007450-A1 LHRH ANALOGS ABBOTT LABORATORIES (US) 1989-08-24 WO claimed
EP-0328089-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 EP claimed
EP-0328090-A2 LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 EP claimed
CN-113874353-B Microbiocidal derivatives 先正达农作物保护股份公司 2024-06-14 CN disclosed
US-20230192628-A1 MICROBIOCIDAL DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-06-22 US disclosed
US-20220272976-A1 MICROBIOCIDAL DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2022-09-01 US disclosed
CN-113924294-A Microbicidal derivatives 先正达农作物保护股份公司 2022-01-11 CN disclosed
CN-113874353-A Microbicidal derivatives 先正达农作物保护股份公司 2021-12-31 CN disclosed
EP-0400065-A1 LHRH ANALOGS. ABBOTT LAB (US) 1990-12-05 EP disclosed
US-4912115-A Cardiovascular disorders DR. KARL THOMAE GMBH (DE) 1990-03-27 US disclosed
WO-1989007450-A1 LHRH ANALOGS ABBOTT LABORATORIES (US) 1989-08-24 WO disclosed
WO-1989007451-A1 REDUCED SIZE LHRH ANALOGS ABBOTT LABORATORIES (US) 1989-08-24 WO disclosed
EP-0328089-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 EP disclosed
EP-0328090-A2 LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220272976-A1 MICROBIOCIDAL DERIVATIVES MPO, MSR1, PRF1 CYP11B1 255/4885CYP11B2 348/4885CYP19A1 599/4885
US-20230192628-A1 MICROBIOCIDAL DERIVATIVES MPO, PRF1, MSR1 CYP11B1 193/4885CYP11B2 252/4885CYP19A1 498/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.